[4-cyano-2,3-bis(fluoranyl)phenyl] 4-(4-octoxycyclohexyl)carbonyloxybenzoate

Systemtic Name: [4-cyano-2,3-bis(fluoranyl)phenyl] 4-(4-octoxycyclohexyl)carbonyloxybenzoate Openeye Name: (4-cyano-2,3-difluoro-phenyl) 4-(4-octoxycyclohexanecarbonyl)oxybenzoate CAS Name: 4-[(4-octoxycyclohexyl)-oxomethoxy]benzoic acid (4-cyano-2,3-difluorophenyl) ester IUPAC Name: (4-cyano-2,3-difluorophenyl) 4-(4-octoxycyclohexanecarbonyl)oxybenzoate Traditional Name: 4-(4-octoxycyclohexanecarbonyl)oxybenzoic acid (4-cyano-2,3-difluoro-phenyl) ester Formula: C29H33F2NO5 MolecularWeight: 513.572826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCCCCCOC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

InChI

InChI=1S/C29H33F2NO5/c1-2-3-4-5-6-7-18-35-23-13-8-20(9-14-23)28(33)36-24-15-10-21(11-16-24)29(34)37-25-17-12-22(19-32)26(30)27(25)31/h10-12,15-17,20,23H,2-9,13-14,18H2,1H3